- InChI
- InChI=1S/C9H10BrCl2FOSi/c1-15(2,9(11)12)14-8-4-3-6(13)5-7(8)10/h3-5,9H,1-2H3
- InChI Key
- YEFBNLXWLMZTDI-UHFFFAOYSA-N
- Formula
- C9H10BrCl2FOSi
- SMILES
-
C[Si](C)(Oc1ccc(F)cc1Br)C(Cl)C
l - Molecular Weight1
- 332.07
- Other Names
-
- 1-Bromo-6-fluoro-2-dichloromethyldimethylsilyloxybenzene
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4529 | Relay (1.0) Calculated Property | |
| ΔfG° | -221.86 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -409.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 65.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.21 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.515 | Crippen Calculated Property | |
| Pc | 2372.75 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1609.00 | NIST | |
| Tboil | 542.74 | K | Relay (1.0) Calculated Property |
| Tc | 769.28 | K | Relay (1.0) Calculated Property |
| Tfus | 297.69 | K | Relay (1.0) Calculated Property |
| Vc | 0.656 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Bromo-4-fluoro-1-dichloromethyldimethylsilyloxybenzene.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- NIST Webbook
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